SpectraBase Spectrum ID |
5mFK96DjCBr |
Name |
m-Coumaric acid ME |
Classification |
Biomolecule |
Copyright |
Copyright © 2023-2025 Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
178.062994179 u |
Formula |
C10H10O3 |
InChI |
InChI=1S/C10H10O3/c1-13-10(12)6-5-8-3-2-4-9(11)7-8/h2-7,11H,1H3/b6-5+ |
InChIKey |
PKALKWFZXXGNJD-AATRIKPKSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
178.187 g/mol |
SMILES |
c1(cc(ccc1)O)\C=C\C(OC)=O |
SPLASH |
splash10-00mk-6900000000-f7cb92563a8d64fa7590 |
Sample Comments |
The MMPW Reference Handbook and associated Tables are attached to Record #1, under the Attachments tab. Refer to these references for an explanation of the Sample Preparation Procedure "Detected" abbreviations, as well as other relevant information pertaining to this database. |
Source of Spectrum |
H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany |
Technique |
GC/MS |
Wiley ID |
MMPW6e_5997 |